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N-[3-[bis(2-hydroxyethyl)amino]propyl]-2-(3-methylbutoxy)benzamide

HCID 54078
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Basic information

CAS
103641-24-3
Standard SMILES
CC(C)CCOc1ccccc1C(=O)NCCCN(CCO)CCO
InChIKey
NXEBKFXFZRUQTD-UHFFFAOYSA-N
Molecular formula
C19H32N2O4
Average molar mass
352.5 g/mol
Monoisotopic mass
352.23620751

Names & identifiers

Preferred name
N-[3-[bis(2-hydroxyethyl)amino]propyl]-2-(3-methylbutoxy)benzamide
IUPAC
N-[3-[bis(2-hydroxyethyl)amino]propyl]-2-(3-methylbutoxy)benzamide
English name
N-[3-[Bis(2-hydroxyethyl)amino]propyl]-2-isopentyloxybenzamide
Molecular formula
C19H32N2O4
Molecular weight
0

Names & synonyms

103641-24-3N-[3-[bis(2-hydroxyethyl)amino]propyl]-2-(3-methylbutoxy)benzamiden-{3-[bis(2-hydroxyethyl)amino]propyl}-2-(3-methylbutoxy)benzamideDTXSID50275600N-[3-[Bis(2-hydroxyethyl)amino]propyl]-2-isopentyloxybenzamide

Database identifiers

CAS
103641-24-3
PubChem CID
54078
DTXSID
DTXSID50275600
Nikkaji
J383.899D

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
82 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
13
Heavy atoms
25
Formal charge
0
Complexity
346

Related reactions

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Compound notes

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